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Information card for entry 1573862
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Coordinates | 1573862.cif |
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Original paper (by DOI) | HTML |
Formula | C16 H15 N O2 |
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Calculated formula | C16 H15 N O2 |
Title of publication | Non-Conjugated Alkyl Chains Engineering to Tune Condensed State Photophysical and Supramolecular Assembly Properties |
Authors of publication | Meher, Niranjan; Khatun, Mst Nasima; Parui, Retwik; Iyer, Parameswar K. |
Journal of publication | Nanoscale |
Year of publication | 2025 |
a | 4.7154 ± 0.001 Å |
b | 12.531 ± 0.003 Å |
c | 22.215 ± 0.004 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1312.7 ± 0.5 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 4 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0647 |
Residual factor for significantly intense reflections | 0.0471 |
Weighted residual factors for significantly intense reflections | 0.109 |
Weighted residual factors for all reflections included in the refinement | 0.1213 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
297626 (current) | 2025-02-07 | cif/ Adding structures of 1573856, 1573857, 1573858, 1573859, 1573860, 1573861, 1573862 via cif-deposit CGI script. |
1573862.cif |
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Users of the data should acknowledge the original authors of the
structural data.